UCSF

ZINC41229897

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2010 20 No

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Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.22 2.89 -13.94 0 5 0 44 293.289 2
Mid Mid (pH 6-8) 0.22 5.24 -51.88 1 5 1 45 294.297 2

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )